Jodrellin B
TL;DR: Jodrellin B (CAS 124901-81-1) is a chemical compound with molecular formula C26H36O8 and molecular weight 476.24103 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[5-(3a,4,5,6a-tetrahydrofuro[2,3-b]furan-5-yl)-2-acetyloxy-4,5-dimethylspiro[9-oxatricyclo[6.2.2.01,6]dodecane-12,2'-oxirane]-10-yl] 2-methylpropanoate
Also Known As: Jodrellin B, [5-(3a,4,5,6a-Tetrahydrofuro[2,3-b]furan-5-yl)-2-acetyloxy-4,5-dimethylspiro[9-oxatricyclo[6.2.2.01,6]dodecane-12,2'-oxirane]-10-yl] 2-methylpropanoate, 5-(Acetyloxy)-7,8-dimethyl-8-(2,3,3a,6a-tetrahydrofuro[2,3-b]furan-2-yl)hexahydro-2H,4H-spiro[2,4a-(epoxymethano)naphthalene-3,2'-oxiran]-9-yl 2-methylpropanoate, Caryoptinol, O18-deacetyl-3-deoxy-2,18-epoxy-O18-(2-methyl-1-oxopropoxy)-, (2alpha,18R)-
Technical Specifications
| Molecular Formula | C26H36O8 |
| Molecular Weight | 476.24103 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 92.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 476.24103 Da |
| Heavy Atoms | 34 |
| Complexity | 916.0 |
| SMILES | CC1CC(C23CC4(CO4)C(CC2C1(C)C5CC6C=COC6O5)OC3OC(=O)C(C)C)OC(=O)C |
| InChIKey | LRQDGRZQEBZSRI-UHFFFAOYSA-N |
Chemical Property Profile of Jodrellin B
Property Insights of Jodrellin B
The XLogP value of 3.5 indicates that Jodrellin B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Jodrellin B. Following Lipinski's Rule of Five, Jodrellin B has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Jodrellin B?
The CAS number of Jodrellin B is 124901-81-1.
What is the molecular formula of Jodrellin B?
The molecular formula of Jodrellin B is C26H36O8.
What is the molecular weight of Jodrellin B?
The molecular weight of Jodrellin B is 476.24103 g/mol.
Where can I buy Jodrellin B?
You can request a quote for Jodrellin B directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Jodrellin B?
Yes, CoreyChem provides custom synthesis services for Jodrellin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.